3-[(E)-4-(2-methyl-1,3-dioxolan-2-yl)but-1-enyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[(E)-4-(2-methyl-1,3-dioxolan-2-yl)but-1-enyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-[(E)-4-(2-methyl-1,3-dioxolan-2-yl)but-1-enyl]naphthalene-1,2-dione CAS Name: 4-hydroxy-3-[(E)-4-(2-methyl-1,3-dioxolan-2-yl)but-1-enyl]naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-[(E)-4-(2-methyl-1,3-dioxolan-2-yl)but-1-enyl]naphthalene-1,2-dione Traditional Name: 4-hydroxy-3-[(E)-4-(2-methyl-1,3-dioxolan-2-yl)but-1-enyl]-1,2-naphthoquinone Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCC=CC2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CC1(OCCO1)CC/C=C/C2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C18H18O5/c1-18(22-10-11-23-18)9-5-4-8-14-15(19)12-6-2-3-7-13(12)16(20)17(14)21/h2-4,6-8,19H,5,9-11H2,1H3/b8-4+